SCHEMBL9511706

SCHEMBL9511706

C=C(I)c1cccs1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL565974 0.79 CES2 (0.64)
SCHEMBL13656482 0.79 CES2 (0.56)
Ethylene SCHEMBL28075502 0.77 CES2 (0.61)
SCHEMBL3338643 0.77
SCHEMBL31560056 0.77 CES2 (0.54)
SCHEMBL5873384 0.77 CES2 (0.61)
SCHEMBL4196929 0.77 CES2 (0.61)
SCHEMBL14082103 0.77
SCHEMBL3338644 0.75
SCHEMBL18868545 0.75

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0319900-B1 FURYL, PHENYLENE AND THIENYL LEUKOTRIENE B4 ANALOGUES G.D. Searle & Co. (US) 1993-09-29 EP disclosed
US-4971997-A ANTIINFLAMMATORY AGENTS, LEUKOTRIENES G. D. SEARLE & CO. (US) 1990-11-20 US disclosed
US-4970229-A ANTIINFLAMMATORY AGENTS G. D. SEARLE & CO. (US) 1990-11-13 US disclosed
US-4970234-A ANTIINFLAMMATORY AGENTS G. D. SEARLE & CO. (US) 1990-11-13 US disclosed
US-4855324-A ANTIINFLAMMATORY AGENTS G. D. SEARLE & CO. (US) 1989-08-08 US disclosed
EP-0319900-A2 Furyl, phenylene and thienyl leukotriene B4 analogues G.D. Searle & Co. (US) 1989-06-14 EP disclosed